3B1T
Crystal structure of human peptidylarginine deiminase 4 in complex with o-Cl-amidine
Entity
Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
1 | A | Protein-arginine deiminase type-4 | polymer | 671 | 74965.9 | 1 | UniProt (Q9UM07) Pfam (PF08526) Pfam (PF08527) Pfam (PF03068) In PDB | Homo sapiens (human) | HL-60 PAD, Peptidylarginine deiminase IV, Protein-arginine deiminase type IV |
2 | A | 2-{[(2S)-1-amino-5-{[(1Z)-2-chloroethanimidoyl]amino}-1-oxopentan-2-yl]carbamoyl}benzoic acid | non-polymer | 354.8 | 1 | Chemie (YCL) | |||
3 | A | SULFATE ION | non-polymer | 96.1 | 3 | Chemie (SO4) | |||
4 | A | CALCIUM ION | non-polymer | 40.1 | 5 | Chemie (CA) | |||
5 | water | water | 18.0 | 154 | Chemie (HOH) |
Sequence modifications
A: 1 - 663 (UniProt: Q9UM07)
PDB | External Database | Details |
---|---|---|
Gly -7 | - | expression tag |
Pro -6 | - | expression tag |
Leu -5 | - | expression tag |
Gly -4 | - | expression tag |
Ser -3 | - | expression tag |
Pro -2 | - | expression tag |
Glu -1 | - | expression tag |
Phe 0 | - | expression tag |
Ser 55 | Gly 55 | SEE REMARK 999 |
Ala 82 | Val 82 | SEE REMARK 999 |
Ala 112 | Gly 112 | SEE REMARK 999 |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 1 |
Total formula weight | 74965.9 | |
Non-Polymers* | Number of molecules | 9 |
Total formula weight | 843.4 | |
All* | Total formula weight | 75809.3 |